Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.41 |
| ▸ | BRD4 | O60885 | 7/20 | 0.41 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | SCN4A | P35499 | 1/20 | 0.34 |
| ▸ | BRD2 | P25440 | 1/20 | 0.33 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.33 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20160241 | 0.79 | PIM1 (0.44) | MAPK14BRD4 | |
| SCHEMBL20160416 | 0.78 | BRD4 (0.55) | BRD4ADORA2BBRD2BRD3BRDT | |
| SCHEMBL20160293 | 0.78 | BRD4 (0.43) | MAPK14BRD4SCN4A | |
| SCHEMBL15549928 | 0.74 | BRD4 (0.53) | BRD4BRD2BRD3BRDT | |
| SCHEMBL29548595 | 0.71 | BRD4 (0.47) | MAPK14BRD4ADORA2A | |
| SCHEMBL20160236 | 0.70 | BRD4 (0.43) | MAPK14BRD4ADORA2ABRD2BRD3 | |
| SCHEMBL20159919 | 0.70 | BRD4 (0.47) | MAPK14BRD4 | |
| SCHEMBL21904846 | 0.70 | BRD4 (0.64) | BRD4BRD2BRD3BRDT | |
| SCHEMBL20159911 | 0.70 | BRD4 (0.43) | MAPK14BRD4BRD2BRD3 | |
| SCHEMBL15553259 | 0.69 | BRD4 (0.71) | BRD4BRD2BRD3BRDT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018086585-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |